SCHEMBL15066529

SCHEMBL15066529

C=C(CC(=O)OC)C(=O)OCCCCCCCCCCCCCCCCCC

nearest known ligand 0.61

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.61
NAAA Q02083 1/20 0.52
RAD52 P43351 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
EPHX1 P07099 1/20 0.49
FAAH O00519 2/20 0.47
POLB P06746 1/20 0.44
POLA1 P09884 1/20 0.44
ACHE P22303 6/20 0.43
DGKA P23743 1/20 0.43
HTR2C P28335 1/20 0.42
HCAR2 Q8TDS4 1/20 0.41

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL16499160 1.00 TSHR (0.61) TSHRNAAARAD52NPSR1EPHX1
SCHEMBL23306340 0.95 TSHR (0.56) TSHRNAAARAD52NPSR1EPHX1
SCHEMBL10057778 0.93 TSHR (0.50) TSHRNAAARAD52NPSR1EPHX1
SCHEMBL9799832 0.91 TSHR (0.62) TSHRNAAARAD52NPSR1EPHX1
SCHEMBL6658433 0.91 TSHR (0.62) TSHRNAAARAD52NPSR1EPHX1
SCHEMBL3128485 0.91 TSHR (0.62) TSHRNAAARAD52NPSR1EPHX1
SCHEMBL892067 0.91 TSHR (0.62) TSHRNAAARAD52NPSR1EPHX1
SCHEMBL3138822 0.91 TSHR (0.62) TSHRNAAARAD52NPSR1EPHX1
SCHEMBL1561906 0.91 TSHR (0.62) TSHRNAAARAD52NPSR1EPHX1
SCHEMBL15156604 0.91 TSHR (0.62) TSHRNAAARAD52NPSR1EPHX1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140377562-A1 NATURAL NANOREINFORCEMENT THAT COMPRISES A LAMINAR SILICATE FROM VOLCANIC SOURCES USEFUL TO MANUFACTURE POLYMERIC NANOCOMPOSITES AND MANUFACTURE PROCESS THEREOF UNIV CHILE (CL) 2014-12-25 US disclosed
EP-2797999-A2 NATURAL NANOREINFORCEMENT THAT COMPRISES A LAMINAR SILICATE FROM VOLCANIC SOURCES USEFUL TO MANUFACTURE POLYMERIC NANOCOMPOSITES AND MANUFACTURE PROCESS THEREOF Universidad De Chile (CL) 2014-11-05 EP disclosed
WO-2013098671-A2 NATURAL NANOREINFORCEMENT THAT COMPRISES A LAMINAR SILICATE FROM VOLCANIC SOURCES USEFUL TO MANUFACTURE POLYMERIC NANOCOMPOSITES AND MANUFACTURE PROCESS THEREOF UNIVERSIDAD DE CHILE (CL) 2013-07-04 WO disclosed